Vitas-M small molecule compound
3-(4-chlorophenyl)-4-({(E)-[4-hydroxy-1-(3-methoxypropyl)-2,6-dioxo-1,6-dihydropyrimidin-5(2H)-ylidene]methyl}amino)butanoic acid
Catalog ID
STK624697
SMILES COCCCN1C(=O)N=C(/C(=C\NCC(c2ccc(cc2)Cl)CC(=O)O)/C1=O)O
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C19H22ClN3O6 MW 423.85 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H22ClN3O6/c1-29-8-2-7-23-18(27)15(17(26)22-19(23)28)11-21-10-13(9-16(24)25)12-3-5-14(20)6-4-12/h3-6,11,13,21H,2,7-10H2,1H3,(H,24,25)(H,22,26,28)/b15-11+InChIKey
VCFFPLLZUVVTLQ-RVDMUPIBSA-NSynonyms
3(4chlorophenyl)4(((E)(1(3methoxypropyl)246trioxo13diazinan5ylidene)methyl)amino)butanoicacid
3(4chlorophenyl)4(((E)(4hydroxy1(3methoxypropyl)26dioxo16dihydropyrimidin5(2H)ylidene)methyl)amino)butanoicacid
COCCCN1C(=O)C(=CNCC(CC(=O)O)C2=CC=C(C=C2)Cl)C(=O)NC1=O
COCCCN1C(=O)N=C(C(=CNCC(c2ccc(cc2)Cl)CC(=O)O)C1=O)O
InChI=1SC19H22ClN3O6c1298272318(27)15(17(26)2219(23)28)11211013(916(24)25)123514(20)6412h36111321H2710H21H3(H2425)(H222628)b1511+
MFCD09790732
ZINC000020623756
ZINC000020623759
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